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861923-83-3

861923-83-3 | "2-benzyl-5-phenyloctahydropyrrolo[3,4-c]pyrrole"

CAS No: 861923-83-3 Catalog No: AG01FMSG MDL No:MFCD29046178

Product Description

Catalog Number:
AG01FMSG
Chemical Name:
"2-benzyl-5-phenyloctahydropyrrolo[3,4-c]pyrrole"
CAS Number:
861923-83-3
Molecular Formula:
C19H22N2
Molecular Weight:
278.3914
MDL Number:
MFCD29046178
IUPAC Name:
2-benzyl-5-phenyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
InChI:
InChI=1S/C19H22N2/c1-3-7-16(8-4-1)11-20-12-17-14-21(15-18(17)13-20)19-9-5-2-6-10-19/h1-10,17-18H,11-15H2
InChI Key:
UZRZIWUMJJIJRL-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CC2C(C1)CN(C2)c1ccccc1

Properties

Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.178g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.399g/mol
Monoisotopic Mass:
278.178g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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